Geometry & MOs

Info

ID:	272317
PubChem CID:	103739642
Reduced:	BrN2S2O3C11H13 (1)
Stoich.:	AB2C2D3E11F13 (1)
Weight, g/mol:	382.9683
ΔH_f, kcal/mol:	-60.46
Dipole, Da:	4.13
IP(EA), eV:	-9.35(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-methyl-N-(3-methylsulfanylcyclohexyl)thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCC2=NC(=C(O2)C)C)Br

DOS

IR

Vibrations